N-(2,5-dimethyl-4-nitrophenyl)acetamide

N-(2,5-dimethyl-4-nitrophenyl)acetamide

CAS: 6954-69-4

Formula: C10H12N2O3

SMILES: CC(=O)NC1=C(C)C=C(C(C)=C1)[N+]([O-])=O

IUPAC: N-(2,5-dimethyl-4-nitrophenyl)acetamide

InChI: InChI=1S/C10H12N2O3/c1-6-5-10(12(14)15)7(2)4-9(6)11-8(3)13/h4-5H,1-3H3,(H,11,13)

Composition: C (57.69%), H (5.81%), N (13.45%), O (23.05%)

Molar Mass: 208.217

Atom Count: 27

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	208.084792254
Formal Charge	0
FSP3	0.3
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	IPRXWEPMOALPTO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.32
Topological Polar Surface Area	72.24
Polarizability	20.64
Ring Count	1
Rotatable Bond Count	2

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